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Details

Stereochemistry RACEMIC
Molecular Formula C15H21N3O
Molecular Weight 259.3467
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of QUINOCIDE

SMILES

COC1=CC2=C(N=CC=C2)C(NCCCC(C)N)=C1

InChI

InChIKey=NBAFIBBHADOTMU-UHFFFAOYSA-N
InChI=1S/C15H21N3O/c1-11(16)5-3-7-17-14-10-13(19-2)9-12-6-4-8-18-15(12)14/h4,6,8-11,17H,3,5,7,16H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C15H21N3O
Molecular Weight 259.3467
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Application of GC-EI-MS for the identification and investigation of positional isomer in primaquine, an antimalarial drug.
2005 Sep 1
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:25:21 GMT 2025
Edited
by admin
on Mon Mar 31 18:25:21 GMT 2025
Record UNII
CNG7995Y4B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PRIMAQUINE RELATED COMPOUND A
USP   USP-RS  
Preferred Name English
QUINOCIDE
INN   MI  
INN  
Official Name English
NSC-50986
Code English
QUINOCIDE [MI]
Common Name English
PRIMAQUINE DIPHOSPHATE IMPURITY A [EP IMPURITY]
Common Name English
quinocide [INN]
Common Name English
PRIMAQUINE DIPHOSPHATE RELATED COMPOUND A [USP IMPURITY]
Common Name English
PRIMAQUINE RELATED COMPOUND A [USP-RS]
Common Name English
PRIMAQUINE RELATED COMPOUND A [USP IMPURITY]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C271
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
Code System Code Type Description
EPA CompTox
DTXSID5045706
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
RS_ITEM_NUM
1561518
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
NCI_THESAURUS
C73004
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
ChEMBL
CHEMBL468403
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
SMS_ID
100000080280
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
MERCK INDEX
m9453
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY Merck Index
PUBCHEM
68928
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
EVMPD
SUB10219MIG
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
FDA UNII
CNG7995Y4B
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
CAS
525-61-1
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
INN
3886
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
MESH
C010775
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
NSC
50986
Created by admin on Mon Mar 31 18:25:21 GMT 2025 , Edited by admin on Mon Mar 31 18:25:21 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT
ENANTIOMER -> RACEMATE
Related Record Type Details
PARENT -> IMPURITY
PEAK VALUE OF 2.0 percent IN USP
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
Related Record Type Details
ACTIVE MOIETY